methyl (2S)-2-[3-(furan-2-ylcarbonylamino)propanoylamino]-3-(4-hydroxyphenyl)propanoate

Systemtic Name: methyl (2S)-2-[3-(furan-2-ylcarbonylamino)propanoylamino]-3-(4-hydroxyphenyl)propanoate Openeye Name: methyl (2S)-2-[3-(furan-2-carbonylamino)propanoylamino]-3-(4-hydroxyphenyl)propanoate CAS Name: (2S)-2-[[3-[[2-furanyl(oxo)methyl]amino]-1-oxopropyl]amino]-3-(4-hydroxyphenyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[3-(furan-2-carbonylamino)propanoylamino]-3-(4-hydroxyphenyl)propanoate Traditional Name: (2S)-2-[3-(2-furoylamino)propanoylamino]-3-(4-hydroxyphenyl)propionic acid methyl ester Formula: C18H20N2O6 MolecularWeight: 360.3612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)O)NC(=O)CCNC(=O)C2=CC=CO2

Isomeric SMILES

COC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)CCNC(=O)C2=CC=CO2

InChI

InChI=1S/C18H20N2O6/c1-25-18(24)14(11-12-4-6-13(21)7-5-12)20-16(22)8-9-19-17(23)15-3-2-10-26-15/h2-7,10,14,21H,8-9,11H2,1H3,(H,19,23)(H,20,22)/t14-/m0/s1